1-(3-chloranyl-4-fluoranyl-phenyl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(3-chloro-4-fluorophenyl)-N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-(3-chloro-4-fluorophenyl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-5-keto-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]pyrrolidine-3-carboxamide Formula: C20H28ClFN3O2+ MolecularWeight: 396.906623

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1CC[NH+](CC1)CCCNC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C20H27ClFN3O2/c1-14-5-9-24(10-6-14)8-2-7-23-20(27)15-11-19(26)25(13-15)16-3-4-18(22)17(21)12-16/h3-4,12,14-15H,2,5-11,13H2,1H3,(H,23,27)/p+1